butyl 4-[[5-(2-hydroxyethyl)-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]amino]benzoate

Systemtic Name: butyl 4-[[5-(2-hydroxyethyl)-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]amino]benzoate Openeye Name: butyl 4-[[5-(2-hydroxyethyl)-6-methyl-4-oxo-1H-pyrimidin-2-yl]amino]benzoate CAS Name: 4-[[5-(2-hydroxyethyl)-6-methyl-4-oxo-1H-pyrimidin-2-yl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[5-(2-hydroxyethyl)-6-methyl-4-oxo-1H-pyrimidin-2-yl]amino]benzoate Traditional Name: 4-[[5-(2-hydroxyethyl)-4-keto-6-methyl-1H-pyrimidin-2-yl]amino]benzoic acid butyl ester Formula: C18H23N3O4 MolecularWeight: 345.39292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC2=NC(=O)C(=C(N2)C)CCO

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC2=NC(=O)C(=C(N2)C)CCO

InChI

InChI=1S/C18H23N3O4/c1-3-4-11-25-17(24)13-5-7-14(8-6-13)20-18-19-12(2)15(9-10-22)16(23)21-18/h5-8,22H,3-4,9-11H2,1-2H3,(H2,19,20,21,23)